COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.390   2.230   0.285  1.00  0.00           C  
HETATM    2  O   UNL     1       7.223   0.818   0.148  1.00  0.00           O  
HETATM    3  C   UNL     1       5.950   0.352   0.072  1.00  0.00           C  
HETATM    4  C   UNL     1       4.884   1.240   0.122  1.00  0.00           C  
HETATM    5  C   UNL     1       3.590   0.774   0.040  1.00  0.00           C  
HETATM    6  C   UNL     1       3.348  -0.598  -0.095  1.00  0.00           C  
HETATM    7  C   UNL     1       1.969  -1.098  -0.184  1.00  0.00           C  
HETATM    8  C   UNL     1       0.932  -0.233  -0.135  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.439  -0.730  -0.223  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.648  -1.925  -0.340  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.571   0.214  -0.170  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.336   1.589  -0.041  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.388   2.475   0.004  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.700   2.017  -0.078  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.732   2.896  -0.032  1.00  0.00           O  
HETATM   16  C   UNL     1      -4.400   4.280   0.100  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.949   0.650  -0.207  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.327   0.122  -0.297  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.515  -1.179  -0.087  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.342  -2.064   0.246  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.140  -2.085   1.762  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.627  -3.485  -0.245  1.00  0.00           C  
HETATM   23  O   UNL     1      -3.154  -1.579  -0.381  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.885  -0.257  -0.254  1.00  0.00           C  
HETATM   25  C   UNL     1       4.424  -1.493  -0.146  1.00  0.00           C  
HETATM   26  C   UNL     1       5.717  -1.017  -0.062  1.00  0.00           C  
HETATM   27  O   UNL     1       6.765  -1.883  -0.116  1.00  0.00           O  
HETATM   28  H   UNL     1       6.945   2.734  -0.573  1.00  0.00           H  
HETATM   29  H   UNL     1       6.900   2.568   1.198  1.00  0.00           H  
HETATM   30  H   UNL     1       8.453   2.468   0.335  1.00  0.00           H  
HETATM   31  H   UNL     1       5.069   2.299   0.226  1.00  0.00           H  
HETATM   32  H   UNL     1       2.763   1.467   0.080  1.00  0.00           H  
HETATM   33  H   UNL     1       1.785  -2.157  -0.288  1.00  0.00           H  
HETATM   34  H   UNL     1       1.117   0.826  -0.031  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.322   1.956   0.024  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.195   3.533   0.104  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.844   4.433   1.025  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.788   4.590  -0.747  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.314   4.872   0.124  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.158   0.773  -0.527  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.507  -1.600  -0.154  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.038  -2.473   2.243  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.292  -2.725   2.007  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.946  -1.073   2.117  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.781  -3.473  -1.324  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.780  -4.128  -0.005  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.523  -3.866   0.246  1.00  0.00           H  
HETATM   48  H   UNL     1       4.243  -2.553  -0.250  1.00  0.00           H  
HETATM   49  H   UNL     1       7.045  -2.215   0.747  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    1                                                 
CONECT    3    4    4   26    2                                       
CONECT    4    5    3    3   31                                       
CONECT    5    6    6    4   32                                       
CONECT    6    7    5    5   25                                       
CONECT    7    8    8    6   33                                       
CONECT    8    9    7    7   34                                       
CONECT    9   11   10   10    8                                       
CONECT   10    9    9                                                 
CONECT   11   12   24   24    9                                       
CONECT   12   13   13   11   35                                       
CONECT   13   14   12   12   36                                       
CONECT   14   15   13   17   17                                       
CONECT   15   16   14                                                 
CONECT   16   15   37   38   39                                       
CONECT   17   14   14   18   24                                       
CONECT   18   17   19   19   40                                       
CONECT   19   18   18   20   41                                       
CONECT   20   19   21   23   22                                       
CONECT   21   20   42   43   44                                       
CONECT   22   20   45   46   47                                       
CONECT   23   24   20                                                 
CONECT   24   17   11   11   23                                       
CONECT   25    6   26   26   48                                       
CONECT   26   25   25    3   27                                       
CONECT   27   26   49                                                 
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
